[1-[4-(2-azanyl-2-oxidanylidene-ethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl] 2-acetyloxybenzoate

Systemtic Name: [1-[4-(2-azanyl-2-oxidanylidene-ethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl] 2-acetyloxybenzoate Openeye Name: [1-[[4-(2-amino-2-oxo-ethyl)phenoxy]methyl]-2-(isopropylamino)ethyl] 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid [1-[4-(2-amino-2-oxoethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-[4-(2-amino-2-oxoethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl] 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [1-[[4-(2-amino-2-keto-ethyl)phenoxy]methyl]-2-(isopropylamino)ethyl] ester Formula: C23H28N2O6 MolecularWeight: 428.47822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)OC(=O)C2=CC=CC=C2OC(=O)C

Isomeric SMILES

CC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)OC(=O)C2=CC=CC=C2OC(=O)C

InChI

InChI=1S/C23H28N2O6/c1-15(2)25-13-19(14-29-18-10-8-17(9-11-18)12-22(24)27)31-23(28)20-6-4-5-7-21(20)30-16(3)26/h4-11,15,19,25H,12-14H2,1-3H3,(H2,24,27)